Ethyl 3-Phenylpropanoate

Ethyl 3-Phenylpropanoate

SCHEMBL6847259

CC=O.CCOC(=O)CCc1ccccc1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.66
CYP4F2 P78329 2/20 0.63
CYP4A11 Q02928 2/20 0.63
ALOX5 P09917 2/20 0.56
ABCB1 P08183 1/20 0.55
CYP4Z1 Q86W10 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
TRPV1 Q8NER1 1/20 0.52
MAPT P10636 1/20 0.50
ALDH1A1 P00352 1/20 0.50
APP P05067 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ethyl 3-Phenylpropanoate SCHEMBL304816 0.93 TDP1 (0.75) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL7440447 0.91 TDP1 (0.72) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL311047 0.88 TDP1 (0.68) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL3322728 0.88 CYP4F2 (0.70) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL28983325 0.88 TDP1 (0.68) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL27762292 0.88 TDP1 (0.68) TDP1CYP4F2CYP4A11ALOX5ABCB1
SCHEMBL2773061 0.87 CYP4F2 (0.68) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL8614481 0.87 TDP1 (0.66) TDP1CYP4F2CYP4A11ALOX5ABCB1
SCHEMBL9858129 0.87 TDP1 (0.66) TDP1CYP4F2CYP4A11ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL27562389 0.85 CYP4F2 (0.66) TDP1CYP4F2CYP4A11ALOX5ABCB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747052-B2 ANTICANCER AGENTS CYTOVIA, INC. 2004-06-08 US disclosed
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-06-05 US disclosed
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2002-09-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 TDP1 1563/4885CYP4F2 3030/4885CYP4A11 2265/4885
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 TDP1 1563/4885CYP4F2 3030/4885CYP4A11 2265/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.